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CHEBI:172463 - Epoxyeremopetasinorol

ChEBI IDCHEBI:172463
ChEBI NameEpoxyeremopetasinorol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20O3
Net Charge0
Average Mass224.300
Monoisotopic Mass224.14124
SMILES[H][C@]12CC[C@H](O)[C@H](C)[C@@]1(C)[C@@]1([H])O[C@@]1(C(C)=O)C2
InChIInChI=1S/C13H20O3/c1-7-10(15)5-4-9-6-13(8(2)14)11(16-13)12(7,9)3/h7,9-11,15H,4-6H2,1-3H3/t7-,9+,10-,11+,12+,13+/m0/s1
InChIKeyIDTQMVOQRHWPMV-KUUXYREKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Epoxyeremopetasinorol (CHEBI:172463) is a oxanes (CHEBI:46942)
IUPAC Name 
1-[(1aR,1bS,2R,3S,5aR,6aS)-3-hydroxy-1b,2-dimethyl-2,3,4,5,5a,6-hexahydro-1aH-indeno[1,2-b]oxiren-6a-yl]ethanone